4-(thiadiazol-4-ylmethyl)thiadiazole

C5H4N4S2 — CID 91257574

IUPAC4-(thiadiazol-4-ylmethyl)thiadiazole
SMILESc1snnc1Cc1csnn1
InChIInChI=1S/C5H4N4S2/c1(4-2-10-8-6-4)5-3-11-9-7-5/h2-3H,1H2
InChIKeyVVFYSKOZNAUKTD-UHFFFAOYSA-N
MW184.25 g/mol
LogP0.98
Rot. Bonds2

About 4-(thiadiazol-4-ylmethyl)thiadiazole

4-(thiadiazol-4-ylmethyl)thiadiazole (PubChem CID 91257574) has the molecular formula C5H4N4S2 and a molecular weight of 184.25 g/mol. Its IUPAC name is 4-(thiadiazol-4-ylmethyl)thiadiazole.

Molecular Properties

Compound Name4-(thiadiazol-4-ylmethyl)thiadiazole
PubChem CID91257574
Molecular FormulaC5H4N4S2
Molecular Weight184.25 g/mol
Exact Mass183.99
IUPAC Name4-(thiadiazol-4-ylmethyl)thiadiazole
SMILESc1snnc1Cc1csnn1
InChIInChI=1S/C5H4N4S2/c1(4-2-10-8-6-4)5-3-11-9-7-5/h2-3H,1H2
InChIKeyVVFYSKOZNAUKTD-UHFFFAOYSA-N
XLogP0.98
TPSA51.56 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.25
LogP ≤ 50.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 4-(thiadiazol-4-ylmethyl)thiadiazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-(thiadiazol-4-ylmethyl)thiadiazole?
The IUPAC name of 4-(thiadiazol-4-ylmethyl)thiadiazole (CID 91257574) is 4-(thiadiazol-4-ylmethyl)thiadiazole.
What is the SMILES notation for 4-(thiadiazol-4-ylmethyl)thiadiazole?
The canonical SMILES for 4-(thiadiazol-4-ylmethyl)thiadiazole is c1snnc1Cc1csnn1.
What is the InChIKey of 4-(thiadiazol-4-ylmethyl)thiadiazole?
The InChIKey is VVFYSKOZNAUKTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H4N4S2/c1(4-2-10-8-6-4)5-3-11-9-7-5/h2-3H,1H2.
What are the key properties of 4-(thiadiazol-4-ylmethyl)thiadiazole?
4-(thiadiazol-4-ylmethyl)thiadiazole has a molecular weight of 184.25 g/mol, XLogP of 0.98, 2 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(thiadiazol-4-ylmethyl)thiadiazole is sourced from PubChem (CID 91257574), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).